BDBM41406 MLS000087455::N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-methoxy-4,5-dihydronaphtho[2,1-d]isoxazole-3-carboxamide::N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-7-methoxy-4,5-dihydrobenz[g]indoxazene-3-carboxamide::SMR000023678::cid_3242723

SMILES COc1ccc2-c3onc(C(=O)Nc4c(C)n(C)n(-c5ccccc5)c4=O)c3CCc2c1

InChI Key InChIKey=WAEKOGFNYIJJNL-UHFFFAOYSA-N

Data  3 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 41406   

TargetCathepsin G(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41406(N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyra...)
Affinity DataIC50: 4.64E+3nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/12/2011
Entry Details
PCBioAssay
TargetE3 ubiquitin-protein ligase SMURF1(Human)
Novartis Institutes of Biomedical Research (NIBR)

Curated by ChEMBL
LigandPNGBDBM41406(N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyra...)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of SMURF1 (unknown origin) assessed as self-ubiquitination by TR-FRET/biochemical assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed
TargetE3 ubiquitin-protein ligase SMURF1(Human)
Novartis Institutes of Biomedical Research (NIBR)

Curated by ChEMBL
LigandPNGBDBM41406(N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyra...)
Affinity DataEC50:  4.66E+3nMAssay Description:Stabilization of SMURF1 (unknown origin) assessed as decrease in auto-ubiquitination by measuring increase in protein level by cell-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed
TargetE3 ubiquitin-protein ligase SMURF2(Homo sapiens)
Novartis Institutes of Biomedical Research (NIBR)

Curated by ChEMBL
LigandPNGBDBM41406(N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyra...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of SMURF2 (unknown origin) assessed as self-ubiquitination by TR-FRET/biochemical assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed